2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol

C14H18N2OS — CID 105058433

IUPAC2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol
SMILESCCc1csc(NC(C)(CO)c2ccccc2)n1
InChIInChI=1S/C14H18N2OS/c1-3-12-9-18-13(15-12)16-14(2,10-17)11-7-5-4-6-8-11/h4-9,17H,3,10H2,1-2H3,(H,15,16)
InChIKeyNANQEXCNBXOUSX-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.03
Rot. Bonds5

About 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol

2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol (PubChem CID 105058433) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol.

Molecular Properties

Compound Name2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol
PubChem CID105058433
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol
SMILESCCc1csc(NC(C)(CO)c2ccccc2)n1
InChIInChI=1S/C14H18N2OS/c1-3-12-9-18-13(15-12)16-14(2,10-17)11-7-5-4-6-8-11/h4-9,17H,3,10H2,1-2H3,(H,15,16)
InChIKeyNANQEXCNBXOUSX-UHFFFAOYSA-N
XLogP3.03
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenyl-2-(1,3,4-thiadiazol-2-ylamino)propan-1-ol
CID 105058401
2-[(6-ethoxy-2-pyridinyl)amino]-2-phenylpropan-1-ol
CID 105058536
4-[(4-ethyl-1,3-thiazol-2-yl)amino]-4-methylpentanoic acid
CID 62963353
(2R)-2-(methylamino)-2-phenylpropan-1-ol
CID 93471124
N-(1-chloro-2-methylbutan-2-yl)-4-ethyl-1,3-thiazol-2-amine
CID 65028401
2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
CID 105060904
2-methyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]propan-1-ol
CID 141197141
2-[(6-bromo-2-propylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
CID 105058671
N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058812
2-[(4-ethyl-1,3-thiazol-2-yl)amino]acetic acid
CID 62960794
2-(isoquinolin-1-ylamino)-2-phenylpropan-1-ol
CID 105058581
2-[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]-2-phenylpropan-1-ol
CID 102686736

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol?
The IUPAC name of 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol (CID 105058433) is 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol.
What is the SMILES notation for 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol?
The canonical SMILES for 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol is CCc1csc(NC(C)(CO)c2ccccc2)n1.
What is the InChIKey of 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol?
The InChIKey is NANQEXCNBXOUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-3-12-9-18-13(15-12)16-14(2,10-17)11-7-5-4-6-8-11/h4-9,17H,3,10H2,1-2H3,(H,15,16).
What are the key properties of 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol?
2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol has a molecular weight of 262.38 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol is sourced from PubChem (CID 105058433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).